SCHEMBL27742974

SCHEMBL27742974

CCCCc1cc(NNC(=O)OCC(Cl)(Cl)Cl)n(-c2ccc(C(C)C)cc2)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ MAPK14 Q16539 1/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ HTT P42858 1/20 0.35
▸ MDM2 Q00987 3/20 0.35
▸ BCL2 P10415 2/20 0.35
▸ MCL1 Q07820 2/20 0.35
▸ ALOX5 P09917 3/20 0.35
▸ PTGS1 P23219 1/20 0.35
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ NPBWR1 P48145 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ NPY1R P25929 1/20 0.32
▸ NPY2R P49146 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL27722384 0.89 ALDH1A1 (0.39) LMNAALDH1A1MAPK14SMN1; SMN2L3MBTL1
SCHEMBL28776251 0.81 SLC16A3 (0.39) LMNAALDH1A1MAPK14SMN1; SMN2L3MBTL1
SCHEMBL7500570 0.80 LMNA (0.46) LMNAALDH1A1MAPK14SMN1; SMN2L3MBTL1
SCHEMBL3185137 0.75 MAPK14 (0.58) MAPK14HPGDGAA
SCHEMBL27944346 0.72 ALDH1A1 (0.51) LMNAALDH1A1L3MBTL1HPGDMDM2
SCHEMBL27767837 0.72 ALDH1A1 (0.58) LMNAALDH1A1L3MBTL1HTTALOX5
SCHEMBL27767901 0.71 LMNA (0.46) LMNAALDH1A1MAPK14L3MBTL1ALOX5
SCHEMBL27794319 0.70 MAP3K7 (0.39) LMNAALDH1A1MAPK14SMN1; SMN2HPGD
SCHEMBL27903551 0.69 ABL1 (0.44) LMNAALDH1A1MAPK14SMN1; SMN2HTT
SCHEMBL27742977 0.68 LMNA (0.49) LMNAALDH1A1SMN1; SMN2L3MBTL1NPC1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101316841-A Arylmethylene urea derivative and use thereof TORAY INDUSTRIES (JP) 2008-12-03 — — CN disclosed
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